SCHEMBL7021733

SCHEMBL7021733

CCCCCCC(C(=O)N1C[C@@H](Oc2ccc(S(C)(=O)=O)cc2)C[C@H]1C(=O)O)n1cnc2cc(-c3ccccc3-c3nnn[nH]3)ccc21

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 8/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7021725 1.00 MCL1 (0.32) MCL1
SCHEMBL7024956 0.93 SLC33A1 (0.31)
SCHEMBL7017568 0.93 KDR (0.30)
SCHEMBL7021775 0.93 KDR (0.30)
SCHEMBL7016267 0.92 PLA2G4A (0.31)
SCHEMBL7016263 0.92 PLA2G4A (0.31)
SCHEMBL7017422 0.92 MCL1 (0.32) MCL1
SCHEMBL8913862 0.92 MCL1 (0.32) MCL1
SCHEMBL8912763 0.92 HDAC3 (0.30)
SCHEMBL7020365 0.91 PTPN11 (0.31) MCL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0574174-B1 Angiotensin II antagonists LILLY CO ELI (US) 2003-08-13 EP disclosed
US-5612360-A AROMATIC N-HETEROCYCLIC COMPOUNDS AS HYPOTENSIVE AGENTS WITH ACID GROUPS, SULFONYLCARBOXAMIDES OR TETRAZOLE GROUPS ELI LILLY AND COMPANY (US) 1997-03-18 US disclosed
US-5569768-A USEFUL IN TREATING HYPERTENSION, CONGESTIVE HEART FAILURE, GLAUCOMA AND RENAL INSUFFICIENCY ELI LILLY AND COMPANY (US) 1996-10-29 US disclosed
EP-0574174-A2 Angiotensin II antagonists ELI LILLY AND COMPANY (US) 1993-12-15 EP disclosed